6-[(3-methoxyphenyl)methoxy]-4-[3-(1-methylpyrazol-4-yl)propanoyl]-1-phenethyl-1,4-diazepan-2-one

Systemtic Name: 6-[(3-methoxyphenyl)methoxy]-4-[3-(1-methylpyrazol-4-yl)propanoyl]-1-phenethyl-1,4-diazepan-2-one Openeye Name: 6-[(3-methoxyphenyl)methoxy]-4-[3-(1-methylpyrazol-4-yl)propanoyl]-1-phenethyl-1,4-diazepan-2-one CAS Name: 6-[(3-methoxyphenyl)methoxy]-4-[3-(1-methyl-4-pyrazolyl)-1-oxopropyl]-1-phenethyl-1,4-diazepan-2-one IUPAC Name: 6-[(3-methoxyphenyl)methoxy]-4-[3-(1-methylpyrazol-4-yl)propanoyl]-1-phenethyl-1,4-diazepan-2-one Traditional Name: 6-m-anisyloxy-4-[3-(1-methylpyrazol-4-yl)propanoyl]-1-phenethyl-1,4-diazepan-2-one Formula: C28H34N4O4 MolecularWeight: 490.59396

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CCC(=O)N2CC(CN(C(=O)C2)CCC3=CC=CC=C3)OCC4=CC(=CC=C4)OC

Isomeric SMILES

CN1C=C(C=N1)CCC(=O)N2CC(CN(C(=O)C2)CCC3=CC=CC=C3)OCC4=CC(=CC=C4)OC

InChI

InChI=1S/C28H34N4O4/c1-30-17-24(16-29-30)11-12-27(33)32-19-26(36-21-23-9-6-10-25(15-23)35-2)18-31(28(34)20-32)14-13-22-7-4-3-5-8-22/h3-10,15-17,26H,11-14,18-21H2,1-2H3